| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 15 | Yes |
Popular Name: (2S)-2-(3,4-difluorophenyl)-2-(isopropylamino)acetonitrile (2S)-2-(3,4-difluorophenyl)-2-(i…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.39 | 5.02 | -7.97 | 1 | 2 | 0 | 36 | 210.227 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.39 | 6.14 | -51.39 | 2 | 2 | 1 | 40 | 211.235 | 3 | ↓ |
